The structure of atomic and molecular clusters, optimised using classical potentials

DOI10.1016/j.cpc.2006.06.003zbMath1196.81287OpenAlexW2013933213WikidataQ57932077 ScholiaQ57932077MaRDI QIDQ709966

D. Kharzeev

Publication date: 18 October 2010

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://figshare.com/articles/journal_contribution/The_structure_of_atomic_and_molecular_clusters_optimised_using_classical_potentials/9386732

zbMATH Keywords

optimisationatomic clusterspotential energy surfacesmany-body potentials

Mathematics Subject Classification ID

Software, source code, etc. for problems pertaining to quantum theory (81-04) Molecular physics (81V55)

Related Items (1)

A reassessment of the Snyman-Fatti dynamic search trajectory method for unconstrained global optimization

Uses Software

• L-BFGS

Cites Work

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• On the limited memory BFGS method for large scale optimization
• Relaxing the assumptions of the multilevel single linkage algorithm
• Topographical multilevel single linkage
• Aspiration based simulated annealing algorithm
• Application of stochastic global optimization algorithms to practical problems
• Efficient algorithms for large scale global optimization: Lennard-Jones clusters
• Approximate energy minimization for large Lennard-Jones clusters
• Stochastic global optimization methods part II: Multi level methods
• Modified controlled random search algorithms

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